Abstract
Vibrationally and rotationally elastic and inelastic collisions between He and I/sub 2/ in the total energy range of 0.044-0.5 eV are treated under the vibrational/rotational infinite-order sudden approximation (VRIOSA). In this method, one simultaneously makes the vibrational energy sudden, rotational energy sudden, and centrifugal sudden approximations and generates a completely uncoupled set of equations. The solution of these equations is discussed and the integral and differential cross sections, the integral and differential cross sections summed over final rotational states, the integral cross sections summed over final rotational and vibrational states, and a type of cross section which recently has been measured experimentally are presented and compared with vibrational close-coupled infinite-order sudden approximation results. The dependence of the accuracy of the VRIOSA upon the choice of the arbitrary vibrational quantum number parameters, n vector, is also investigated. Setting n vector equal to the final vibrational quantum number gives good results for the integral and experimental cross sections, while picking n vector equal to the average of the initial and final vibrational quantum numbers gives good results for the differential cross sections. The present comparisons involving a full three-dimensional system and quantities, such as the differential cross section, which are sensitive tomore » the phase of the S matrix extend earlier, more limited studies and show that the VRIOSA should be considered convenient and reliable for light atom-heavy diatomic molecule collisions at total energies up to a few electronvolts.« less
Published Version
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